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	hartrees
Energy at 0K	-31.360709
Energy at 298.15K	-31.371581
Nuclear repulsion energy	81.500480

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3259	2927	93.59
2	A₁	3150	2829	251.47
3	A₁	1638	1471	16.76
4	A₁	1622	1457	0.39
5	A₁	1327	1191	23.45
6	A₁	907	815	20.64
7	A₁	402	361	10.49
8	A₂	3288	2952	0.00
9	A₂	1620	1455	0.00
10	A₂	1153	1036	0.00
11	A₂	263	236	0.00
12	E	3297	2961	102.82
12	E	3297	2961	102.82
13	E	3249	2917	60.93
13	E	3249	2917	60.93
14	E	3135	2815	53.70
14	E	3135	2815	53.70
15	E	1641	1474	9.52
15	E	1641	1474	9.52
16	E	1617	1452	7.12
16	E	1617	1452	7.12
17	E	1578	1417	7.56
17	E	1578	1417	7.56
18	E	1432	1286	19.59
18	E	1432	1286	19.59
19	E	1218	1094	11.87
19	E	1218	1094	11.87
20	E	1146	1030	22.26
20	E	1146	1030	22.26
21	E	452	406	0.03
21	E	452	406	0.03
22	E	294	264	0.38
22	E	294	264	0.38

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.399
C2	0.000	1.386	-0.048
C3	1.200	-0.693	-0.048
C4	-1.200	-0.693	-0.048
H5	0.000	1.480	-1.145
H6	1.281	-0.740	-1.145
H7	-1.281	-0.740	-1.145
H8	-0.882	1.899	0.336
H9	0.882	1.899	0.336
H10	2.085	-0.185	0.336
H11	1.203	-1.713	0.336
H12	-1.203	-1.713	0.336
H13	-2.085	-0.185	0.336
X14	0.000	0.000	1.399

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.4560	1.4560	1.4560	2.1390	2.1390	2.1390	2.0947	2.0947	2.0947	2.0947	2.0947	2.0947	1.0000
C2	1.4560		2.3999	2.3999	1.1013	2.7136	2.7136	1.0904	1.0904	2.6390	3.3465	3.3465	2.6390	2.0037
C3	1.4560	2.3999		2.3999	2.7136	1.1013	2.7136	3.3465	2.6390	1.0904	1.0904	2.6390	3.3465	2.0037
C4	1.4560	2.3999	2.3999		2.7136	2.7136	1.1013	2.6390	3.3465	3.3465	2.6390	1.0904	1.0904	2.0037
H5	2.1390	1.1013	2.7136	2.7136		2.5629	2.5629	1.7740	1.7740	3.0520	3.7198	3.7198	3.0520	2.9436
H6	2.1390	2.7136	1.1013	2.7136	2.5629		2.5629	3.7198	3.0520	1.7740	1.7740	3.0520	3.7198	2.9436
H7	2.1390	2.7136	2.7136	1.1013	2.5629	2.5629		3.0520	3.7198	3.7198	3.0520	1.7740	1.7740	2.9436
H8	2.0947	1.0904	3.3465	2.6390	1.7740	3.7198	3.0520		1.7646	3.6264	4.1710	3.6264	2.4064	2.3484
H9	2.0947	1.0904	2.6390	3.3465	1.7740	3.0520	3.7198	1.7646		2.4064	3.6264	4.1710	3.6264	2.3484
H10	2.0947	2.6390	1.0904	3.3465	3.0520	1.7740	3.7198	3.6264	2.4064		1.7646	3.6264	4.1710	2.3484
H11	2.0947	3.3465	1.0904	2.6390	3.7198	1.7740	3.0520	4.1710	3.6264	1.7646		2.4064	3.6264	2.3484
H12	2.0947	3.3465	2.6390	1.0904	3.7198	3.0520	1.7740	3.6264	4.1710	3.6264	2.4064		1.7646	2.3484
H13	2.0947	2.6390	3.3465	1.0904	3.0520	3.7198	1.7740	2.4064	3.6264	4.1710	3.6264	1.7646		2.3484
X14	1.0000	2.0037	2.0037	2.0037	2.9436	2.9436	2.9436	2.3484	2.3484	2.3484	2.3484	2.3484	2.3484

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	112.795	N1	C2	H8	109.862
N1	C2	H9	109.862	N1	C3	H6	112.795
N1	C3	H10	109.862	N1	C3	H11	109.862
N1	C4	H7	112.795	N1	C4	H12	109.862
N1	C4	H13	109.862	C2	N1	C3	111.002
C2	N1	C4	111.002	C2	N1	X14	107.893
C3	N1	C4	111.002	C3	N1	X14	107.893
C4	N1	X14	107.893	H5	C2	H8	108.080
H5	C2	H9	108.080	H6	C3	H10	108.080
H6	C3	H11	108.080	H7	C4	H12	108.080
H7	C4	H13	108.080	H8	C2	H9	108.026
H10	C3	H11	108.026	H12	C4	H13	108.026

All results from a given calculation for N(CH₃)₃ (Trimethylamine)

using model chemistry: HF/CEP-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	N	-0.163
2	C	-0.317
3	C	-0.317
4	C	-0.317
5	H	0.083
6	H	0.083
7	H	0.083
8	H	0.144
9	H	0.144
10	H	0.144
11	H	0.144
12	H	0.144
13	H	0.144

<r²>	78.314
(<r²>)^1/2	8.850

All results from a given calculation for N(CH3)3 (Trimethylamine)

using model chemistry: HF/CEP-31G*

States and conformations

All results from a given calculation for N(CH₃)₃ (Trimethylamine)